SMILES:
CC(=O)NNC(=O)CC1CCCN1c1ccc(C#N)c(Cl)c1CMolecular Processing
Molecular formula
C16H19ClN4O2
Molecular weight
334.81
Exact mass
334.1197
XLogP
2.05
TPSA
85.23
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
23
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
87.85
Supplementary Information
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